SCHEMBL14734686

SCHEMBL14734686

CC(=O)NC1COC(CO)[C@H](OS(=O)(=O)O)[C@@H]1O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ OGA O60502 3/20 0.38
▸ LGALS3 P17931 1/20 0.38
▸ MAPK1 P28482 2/20 0.35
▸ ALDH1A1 P00352 1/20 0.33
▸ THRB P10828 1/20 0.33
▸ CD69 Q07108 1/20 0.33
▸ SELL P14151 1/20 0.33
▸ SELP P16109 1/20 0.33
▸ PYGB P11216 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL22204690 0.79 OGA (0.38) OGALGALS3MAPK1ALDH1A1THRB
SCHEMBL22757197 0.79 OGA (0.38) OGAMAPK1
SCHEMBL18806977 0.78 OGA (0.46) OGALGALS3MAPK1ALDH1A1THRB
SCHEMBL16869797 0.78 OGA (0.46) OGALGALS3MAPK1ALDH1A1THRB
SCHEMBL23705039 0.78 OGA (0.46) OGALGALS3MAPK1ALDH1A1THRB
SCHEMBL23603516 0.78 OGA (0.46) OGALGALS3MAPK1ALDH1A1THRB
SCHEMBL12178004 0.78 OGA (0.46) OGALGALS3MAPK1ALDH1A1THRB
SCHEMBL18806954 0.78 OGA (0.46) OGALGALS3MAPK1ALDH1A1THRB
SCHEMBL18857576 0.78 OGA (0.46) OGALGALS3MAPK1ALDH1A1THRB
SCHEMBL12085189 0.78 OGA (0.46) OGALGALS3MAPK1ALDH1A1THRB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1541580-B1 Sulfotransferase inhibitors SEIKAGAKU KOGYO CO LTD (JP) 2013-02-27 — — EP disclosed
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